| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 9th, 2010 | 24 | Yes |
Popular Name: 3-(3-butyl-2,6-dioxo-7-pentyl-purin-1-yl)propanenitrile 3-(3-butyl-2,6-dioxo-7-pentyl-pu…
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| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.90 | 12.09 | -12.3 | 0 | 7 | 0 | 86 | 331.42 | 9 | ↓ |
